SCHEMBL8300985

SCHEMBL8300985

O=C(NCc1ccc2c(c1)OCO2)c1cc(Cl)ccc1NCc1ccncc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 2/20 0.65
KDR P35968 2/20 0.65
HSD17B10 Q99714 2/20 0.61
POLB P06746 2/20 0.58
MAPT P10636 3/20 0.55
HPGD P15428 4/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
TSHR P16473 2/20 0.55
ALDH1A1 P00352 2/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2C9 P11712 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
AURKA O14965 1/20 0.53
MAPK1 P28482 3/20 0.53
KDM4E B2RXH2 1/20 0.53
LMNA P02545 1/20 0.53
TP53 P04637 1/20 0.53
ALOX12 P18054 1/20 0.53

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8297761 0.87 HSD17B10 (0.69) HSD17B10POLBMAPTHPGDMEN1
SCHEMBL8301382 0.85 MCHR1 (0.63) HSD17B10POLBMAPTHPGDMEN1
SCHEMBL8300984 0.83 FLT1 (0.46) FLT1KDRHSD17B10POLBHPGD
SCHEMBL8293093 0.81 HPGD (0.59) HSD17B10POLBMAPTHPGDMEN1
SCHEMBL8300413 0.81 MEN1 (0.58) HSD17B10POLBMAPTHPGDMEN1
SCHEMBL8300986 0.80 HPGD (0.71) HSD17B10POLBHPGDMEN1KMT2A
SCHEMBL6942060 0.79 MEN1 (0.57) HSD17B10POLBMAPTHPGDMEN1
SCHEMBL6941709 0.79 HPGD (0.64) HSD17B10POLBMAPTHPGDMEN1
Hydrochloric Acid SCHEMBL6945449 0.78 MEN1 (0.56) HSD17B10POLBMAPTHPGDMEN1
SCHEMBL8299752 0.78 HPGD (0.55) HSD17B10POLBMAPTHPGDMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0686625-B1 ANTHRANILIC ACID DERIVATIVE EISAI CO LTD (JP) 1999-05-26 EP disclosed
US-5716993-A PHOSPHODIESTERASE ENZYME INHIBITOR FOR TREATING CARDIOVASCULAR DISORDER, ANGINA PECTORIS, HYPERTENSION, ASTHMA EISAI CO., LTD. (JP) 1998-02-10 US disclosed
EP-0686625-A1 ANTHRANILIC ACID DERIVATIVE Eisai Co., Ltd. (JP) 1995-12-13 EP disclosed